Geometry & MOs

Info

ID:	298257
PubChem CID:	117648154
Reduced:	OBr2C12H12 (1)
Stoich.:	AB2C12D12 (1)
Weight, g/mol:	175.099714
ΔH_f, kcal/mol:	-6.51
Dipole, Da:	3.54
IP(EA), eV:	-9.68(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,5-trimethyl-1H-indol-3-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1Br)Br)C(=O)C(C)C=C

DOS

IR

Vibrations